EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H28N4O5 |
| Net Charge | 0 |
| Average Mass | 464.522 |
| Monoisotopic Mass | 464.20597 |
| SMILES | O=C(O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H]1CCCN1 |
| InChI | InChI=1S/C25H28N4O5/c30-17-9-7-15(8-10-17)12-22(25(33)34)29-24(32)21(28-23(31)20-6-3-11-26-20)13-16-14-27-19-5-2-1-4-18(16)19/h1-2,4-5,7-10,14,20-22,26-27,30H,3,6,11-13H2,(H,28,31)(H,29,32)(H,33,34)/t20-,21-,22-/m0/s1 |
| InChIKey | DIDLUFMLRUJLFB-FKBYEOEOSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pro-Trp-Tyr (CHEBI:162733) is a tripeptide (CHEBI:47923) |
| IUPAC Name |
|---|
| (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-3-(1H-indol-3-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoic acid |